Structure Information
Structure

Compound Identification

SMILES

C\C=C(/C)C(=O)O[C@H]1C[C@@H](OC(C)=O)[C@@]2(C)CO[C@@H]3[C@@H]2[C@]11CO[C@H](O)[C@H]1[C@@](C)([C@@H]3O)[C@]12O[C@@]1(C)[C@H]1C[C@@H]2O[C@@H]2OC=C[C@]12O

InChIKey

InChIKey=DTVGLMFEPSBEIA-GSWRAVRCSA-N

Formula

C32H42O12

Mass

618.676

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Triterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Limonoids

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Limonoid skeleton - Furopyran - Fatty acid ester - Oxepane - Dicarboxylic acid or derivatives - Oxane - Pyran - Fatty acyl - Tetrahydrofuran - Tertiary alcohol - Dihydrofuran - Cyclic alcohol - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Furan - Secondary alcohol - Hemiacetal - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Ether - Oxirane - Organoheterocyclic compound - Acetal - Dialkyl ether - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as limonoids. These are highly oxygenated, modified terpenoids with a prototypical structure either containing or derived from a precursor with a 4,4,8-trimethyl-17-furanylsteroid skeleton. All naturally occurring citrus limonoids contain a furan ring attached to the D-ring, at C-17, as well as oxygen containing functional groups at C-3, C-4, C-7, C-16 and C-17.

External Descriptors

CHEBI:38520 : azadirachtin

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